1-[(1-methylpyrazol-4-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1-methylpyrazol-4-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1-methylpyrazol-4-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(1-methyl-4-pyrazolyl)methyl]-N-[4-(1-pyrazolyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1-methylpyrazol-4-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-methylpyrazol-4-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidin-1-ium-4-carboxamide Formula: C20H25N6O+ MolecularWeight: 365.4521

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C20H24N6O/c1-24-14-16(13-22-24)15-25-11-7-17(8-12-25)20(27)23-18-3-5-19(6-4-18)26-10-2-9-21-26/h2-6,9-10,13-14,17H,7-8,11-12,15H2,1H3,(H,23,27)/p+1